UCSF

ZINC14163993

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2008 45 No

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Annotations

Vendors

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 9.29 14.09 -16.77 4 8 0 134 628.847 25
Hi High (pH 8-9.5) 9.29 14.86 -60.49 3 8 -1 136 627.839 25

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.